In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 19 | Yes |
Popular Name: N'-[(2-bromo-5-methoxy-phenyl)methyl]-N,N-diethyl-propane-1,3-diamine N'-[(2-bromo-5-methoxy-phenyl)me…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.34 | 7.18 | -32.56 | 2 | 3 | 1 | 26 | 330.29 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 6.42 | -36.56 | 2 | 3 | 1 | 29 | 330.29 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 8.58 | -98.79 | 3 | 3 | 2 | 30 | 331.298 | 9 | ↓ |